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D-Homopregn-4-ene-3,20-dione, 15,16-dihydroxy-, (15.alpha.,16.alpha.)-
SpectraBase Compound ID Jv5O158wjAW
InChI InChI=1S/C22H32O4/c1-12(23)17-11-18(25)20(26)19-15-5-4-13-10-14(24)6-8-21(13,2)16(15)7-9-22(17,19)3/h10,15-20,25-26H,4-9,11H2,1-3H3/t15?,16?,17?,18-,19?,20-,21-,22?/m0/s1
InChIKey IQPDQWHGIKOEBP-QAYSDZDDSA-N
Mol Weight 360.5 g/mol
Molecular Formula C22H32O4
Exact Mass 360.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUsBbkEnz1b
Name D-Homopregn-4-ene-3,20-dione, 15,16-dihydroxy-, (15.alpha.,16.alpha.)-
CAS Registry Number 72921-24-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O4
InChI InChI=1S/C22H32O4/c1-12(23)17-11-18(25)20(26)19-15-5-4-13-10-14(24)6-8-21(13,2)16(15)7-9-22(17,19)3/h10,15-20,25-26H,4-9,11H2,1-3H3/t15?,16?,17?,18-,19?,20-,21-,22?/m0/s1
InChIKey IQPDQWHGIKOEBP-QAYSDZDDSA-N
Molecular Weight 360.494 g/mol
SMILES O[C@@]1(C2C(C(C[C@@]1(O)[H])C(=O)C)(CCC1[C@@]3(C(CCC21)=CC(CC3)=O)C)C)[H]
SPLASH splash10-03kc-2439000000-3d1d61b0230cc30d4ad9
Source of Spectrum K-113-214-0
Synonyms (4aR,9S,10R)-7-acetyl-9,10-dihydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,7,8,9,10,10a,10b,11,12-tetradecahydro-2(3H)-chrysenone 15.alpha.,16.alpha.-dihydroxy-D-homo-4-pregnen-3,20-dione
Wiley ID 1348546